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1449598-75-7 | Pyrazolo[1,5-a]pyrazine-2-carboxylic acid, 4-chloro-6-methyl-, ethyl ester
CAS No: 1449598-75-7 Catalog No: AG001KDQ MDL No:MFCD28143931
Product Description
Catalog Number:
AG001KDQ
Chemical Name:
Pyrazolo[1,5-a]pyrazine-2-carboxylic acid, 4-chloro-6-methyl-, ethyl ester
CAS Number:
1449598-75-7
Molecular Formula:
C10H10ClN3O2
Molecular Weight:
239.6583
MDL Number:
MFCD28143931
IUPAC Name:
ethyl 4-chloro-6-methylpyrazolo[1,5-a]pyrazine-2-carboxylate
InChI:
InChI=1S/C10H10ClN3O2/c1-3-16-10(15)7-4-8-9(11)12-6(2)5-14(8)13-7/h4-5H,3H2,1-2H3
InChI Key:
UFBGDLZUWIWIAT-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nn2c(c1)c(Cl)nc(c2)C
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.046g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.659g/mol
Monoisotopic Mass:
239.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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